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4-keto-3-(phenylseleno)cyclohexane-1,1,3-tricarboxylic acid trimethyl ester
SpectraBase Compound ID 5d7IrSYsORR
InChI InChI=1S/C18H20O7Se/c1-23-14(20)17(15(21)24-2)10-9-13(19)18(11-17,16(22)25-3)26-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3
InChIKey AAHGJYDKAXHJTO-UHFFFAOYSA-N
Mol Weight 427.32 g/mol
Molecular Formula C18H20O7Se
Exact Mass 428.037425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WOHpXQeUv
Name 4-keto-3-(phenylseleno)cyclohexane-1,1,3-tricarboxylic acid trimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O7Se
InChI InChI=1S/C18H20O7Se/c1-23-14(20)17(15(21)24-2)10-9-13(19)18(11-17,16(22)25-3)26-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3
InChIKey AAHGJYDKAXHJTO-UHFFFAOYSA-N
Molecular Weight 427.323 g/mol
SMILES C1(CC(C(=O)OC)(C(=O)OC)CCC1=O)(C(=O)OC)[Se]c1ccccc1
SPLASH splash10-0ue9-0790000000-2b2cd0597d34c9a92317
Source of Spectrum J-59-6714-7
Synonyms 4-Oxo-3-(phenylseleno)cyclohexane-1,1,3-tricarboxylic acid trimethyl ester Trimethyl 4-oxidanylidene-3-phenylselanyl-cyclohexane-1,1,3-tricarboxylate Trimethyl 4-oxo-3-phenylselanyl-cyclohexane-1,1,3-tricarboxylate
Wiley ID 1380550